1-(4-ethoxyphenyl)sulfonyl-4-propyl-piperazin-4-ium

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-4-propyl-piperazin-4-ium Openeye Name: 1-(4-ethoxyphenyl)sulfonyl-4-propyl-piperazin-4-ium CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-propylpiperazin-4-ium IUPAC Name: 1-(4-ethoxyphenyl)sulfonyl-4-propylpiperazin-4-ium Traditional Name: 1-p-phenetylsulfonyl-4-propyl-piperazin-4-ium Formula: C15H25N2O3S+ MolecularWeight: 313.4356

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C15H24N2O3S/c1-3-9-16-10-12-17(13-11-16)21(18,19)15-7-5-14(6-8-15)20-4-2/h5-8H,3-4,9-13H2,1-2H3/p+1